1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one
TL;DR: 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one (CAS 21005-24-3) is a chemical compound with molecular formula C10H9N3O3 and molecular weight 219.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(hydroxyamino)-2-nitrosoindol-1-yl]ethanone
Also Known As: Acetylisatindioxim, Tricyclodecenyl acetate, Isatin, 1-acetyl-, dioxime, 1-Acetylindole-2,3-dione 2,3-dioxime, Indole-2,3-dione, 1-acetyl-, 2,3-dioxime
| Molecular Formula | C10H9N3O3 |
|---|---|
| Molecular Weight | 219.06 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 83.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 219.06439 |
| Heavy Atoms | 16 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 21005-24-3 |
|---|---|
| SMILES | CC(=O)N1C2=CC=CC=C2C(=C1N=O)NO |
| InChIKey | PBUGLFUDRMHMKD-UHFFFAOYSA-N |
Product Overview
1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one (CAS 21005-24-3), with molecular formula C10H9N3O3 and molecular weight 219.06 g/mol. IUPAC: 1-[3-(hydroxyamino)-2-nitrosoindol-1-yl]ethanone.
Chemical Property Profile of 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one
Property Insights of 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one. The TPSA of 83.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one. Following Lipinski's Rule of Five, 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one?
The CAS number of 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one is 21005-24-3.
What is the molecular formula of 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one?
The molecular formula of 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one is C10H9N3O3.
What is the molecular weight of 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one?
The molecular weight of 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one is 219.06 g/mol.
Where can I buy 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one?
You can request a quote for 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-(Hydroxyamino)-2-nitroso-1H-indol-1-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.